Compound
| ID: | N3927 | |
|---|---|---|
| Name: | toluene, 1-butyl-3-methylimidazolium thiocyanate | |
| Description: | toluene [MBIm]+[SCN]- | |
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C8H15N2.C7H8.CHNS/c1-3-4-5-10-7-6-9(2)8-10;1-7-5-3-2-4-6-7;2-1-3/h6-8H,3-5H2,1-2H3;2-6H,1H3;3H/q+1;;/p-1 |
Properties
logK: Gas-ionic liquid partition coefficient
| Value | Source or prediction |
|---|---|
| 3.015 |
experimental value |
| 2.988889528143587 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
| 3.039798004153382 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |